N-Desmethylvinblastine
[CAS# 18172-50-4]

Identification

• Name: N-Desmethylvinblastine
• Synonyms: Brn 4227361; N-Deformylleurocristine; N-Deformylvincristine
• Molecular Formula: C₄₅H₅₆N₄O₉
• Molecular Weight: 796.96
• CAS Registry Number: 18172-50-4
• SMILES: C5=C4C13C2N(CC1)CC=CC2(C(OC(=O)C)C(O)(C3NC4=CC(=C5C8(C7=C(C6=CC=CC=C6[NH]7)CCN9CC(C8)CC(O)(C9)CC)C(OC)=O)OC)C(OC)=O)CC
• InChI: 1S/C45H56N4O9/c1-7-41(53)22-27-23-44(39(51)56-5,35-29(14-18-48(24-27)25-41)28-12-9-10-13-32(28)46-35)31-20-30-33(21-34(31)55-4)47-36-43(30)16-19-49-17-11-15-42(8-2,37(43)49)38(58-26(3)50)45(36,54)40(52)57-6/h9-13,15,20-21,27,36-38,46-47,53-54H,7-8,14,16-19,22-25H2,1-6H3
• InChIKey: OBEIXXHHUOSBLA-UHFFFAOYSA-N

Properties

• Density: 1.385g/cm³ (Cal.)